SCHEMBL8658157

SCHEMBL8658157

NC(=O)Nc1cc(-c2ccccn2)ccc1CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 2/20 0.43
▸ SUCNR1 Q9BXA5 5/20 0.43
▸ HDAC1 Q13547 3/20 0.42
▸ F11 P03951 2/20 0.42
▸ HCAR2 Q8TDS4 1/20 0.42
▸ TPSB2 P20231 1/20 0.42
▸ HDAC2 Q92769 3/20 0.42
▸ MAPK14 Q16539 1/20 0.42
▸ SMO Q99835 1/20 0.42
▸ P2RX7 Q99572 1/20 0.41
▸ CHEK2 O96017 1/20 0.40
▸ CNR1 P21554 1/20 0.40
▸ WNT3A P56704 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ DHODH Q02127 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11379844 0.76 GRM4 (0.49) P2RX7CHEK2CNR1ABL1
SCHEMBL5151907 0.75 SUCNR1 (0.48) SUCNR1HDAC1HDAC2
SCHEMBL5270832 0.74 SUCNR1 (0.56) CFDSUCNR1F11TPSB2
SCHEMBL5474559 0.73 TRPV1 (0.58) CNR1GFER
SCHEMBL9724473 0.72 CXCL8 (0.57) CFDSUCNR1F11TPSB2
SCHEMBL11008600 0.72 CXCL8 (0.58) SUCNR1
SCHEMBL11008421 0.72 CXCL8 (0.46) HDAC1
SCHEMBL30433544 0.71 ABCC4 (0.61) HCAR2WNT3AKDM4EGFERDHODH
SCHEMBL538208 0.71 ABCC4 (0.61) HCAR2WNT3AKDM4EGFERDHODH
SCHEMBL4688780 0.71 FFAR1 (0.60) CNR1WNT3AKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842196-A1 CELL ADHESION INHIBITORS BIOGEN, INC. (US) 1998-05-20 — — EP disclosed
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